Geometry & MOs

Info

ID:	292143
PubChem CID:	114465840
Reduced:	S2N3O4C11H15 (1)
Stoich.:	A2B3C4D11E15 (1)
Weight, g/mol:	331.039355
ΔH_f, kcal/mol:	-103.82
Dipole, Da:	3.45
IP(EA), eV:	-9.1(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[[2-(3-aminoprop-1-ynyl)-4-chlorophenyl]sulfamoyl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)NS(=O)(=O)NCC1=CC(=CS1)C#CCN

DOS

IR

Vibrations